SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '074'


List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DSS_G_CCSG149_0
(D-GLYCERALDEHYDE-3-P
HOSPHATE-DEHYDROGENA
SE)		 1uw1 ARTIFICIAL
NUCLEOTIDE BINDING
PROTEIN (ANBP)
(synthetic
construct) 		4 / 7 ASN A  32
CYH A  46
ASN A  44
TYR A  43
 ADP  A1074 ( 4.9A)
ZN  A1075 (-2.4A)
None
ADP  A1074 (-3.6A)
 0.98A 1dssG-1uw1A:
undetectable		 1dssG-1uw1A:
12.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DSS_R_CCSR149_0
(D-GLYCERALDEHYDE-3-P
HOSPHATE-DEHYDROGENA
SE)		 1uw1 ARTIFICIAL
NUCLEOTIDE BINDING
PROTEIN (ANBP)
(synthetic
construct) 		4 / 8 ASN A  32
CYH A  46
ASN A  44
TYR A  43
 ADP  A1074 ( 4.9A)
ZN  A1075 (-2.4A)
None
ADP  A1074 (-3.6A)
 1.00A 1dssR-1uw1A:
undetectable		 1dssR-1uw1A:
12.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 1qdq CATHEPSIN B
(Bos
taurus) 		7 / 10 GLN A  23
GLY A  27
SER A  28
TRP A  30
PHE A  32
HIS A 199
ALA A 200
 074  A 254 ( 3.1A)
074  A 254 ( 3.3A)
None
None
None
074  A 254 ( 3.9A)
074  A 254 ( 4.3A)
 0.30A 1stfE-1qdqA:
27.5
1stfI-1qdqA:
undetectable		 1stfE-1qdqA:
32.20
1stfI-1qdqA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TW4_A_CHDA130_1
(FATTY ACID-BINDING
PROTEIN)		 4uut HOMEOTIC PROTEIN
ULTRABITHORAX
(Drosophila
melanogaster) 		3 / 3 TYR A   8
ARG A  53
GLN A  50
 None
SO4  A1074 (-4.0A)
None
 1.03A 1tw4A-4uutA:
undetectable		 1tw4A-4uutA:
17.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 1qdq CATHEPSIN B
(Bos
taurus) 		6 / 7 GLN A  23
GLY A  27
HIS A 110
HIS A 111
HIS A 199
TRP A 221
 074  A 254 ( 3.1A)
074  A 254 ( 3.3A)
074  A 254 ( 3.6A)
074  A 254 ( 3.9A)
074  A 254 ( 3.9A)
074  A 254 (-3.5A)
 0.44A 3ai8A-1qdqA:
45.0		 3ai8A-1qdqA:
88.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AI8_B_HNQB255_1
(CATHEPSIN B)		 1qdq CATHEPSIN B
(Bos
taurus) 		5 / 6 GLN A  23
GLY A  27
HIS A 110
HIS A 111
TRP A 221
 074  A 254 ( 3.1A)
074  A 254 ( 3.3A)
074  A 254 ( 3.6A)
074  A 254 ( 3.9A)
074  A 254 (-3.5A)
 0.42A 3ai8B-1qdqA:
44.9		 3ai8B-1qdqA:
88.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DMT_C_CCSC166_0
(GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL)		 1uw1 ARTIFICIAL
NUCLEOTIDE BINDING
PROTEIN (ANBP)
(synthetic
construct) 		4 / 8 ASN A  32
CYH A  46
ASN A  44
TYR A  43
 ADP  A1074 ( 4.9A)
ZN  A1075 (-2.4A)
None
ADP  A1074 (-3.6A)
 0.94A 3dmtC-1uw1A:
undetectable		 3dmtC-1uw1A:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L2V_A_RLTA397_1
(INTEGRASE)		 2yoc PULLULANASE
(Klebsiella
oxytoca) 		4 / 7 ASP A 665
GLN A 700
GLN A 709
GLU A 694
 None
CA  A2074 ( 4.5A)
None
None
 1.24A 3l2vA-2yocA:
undetectable		 3l2vA-2yocA:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RAE_F_LFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 1qdq CATHEPSIN B
(Bos
taurus) 		3 / 4 SER A 220
GLY A  74
GLU A  66
 None
074  A 254 (-4.3A)
None
 0.59A 3raeA-1qdqA:
undetectable
3raeC-1qdqA:
undetectable		 3raeA-1qdqA:
17.79
3raeC-1qdqA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JUO_F_LFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B
E-SITE DNA)		 1qdq CATHEPSIN B
(Bos
taurus) 		3 / 4 SER A 220
GLY A  74
GLU A  66
 None
074  A 254 (-4.3A)
None
 0.51A 4juoA-1qdqA:
undetectable
4juoC-1qdqA:
undetectable		 4juoA-1qdqA:
17.79
4juoC-1qdqA:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LBT_A_6T0A303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 1qdq CATHEPSIN B
(Bos
taurus) 		5 / 10 PHE A 231
ILE A 242
PHE A 180
TRP A 225
GLY A 198
 None
None
None
None
074  A 254 (-4.7A)
 1.49A 5lbtA-1qdqA:
undetectable
5lbtB-1qdqA:
undetectable		 5lbtA-1qdqA:
22.91
5lbtB-1qdqA:
22.91